Information card for entry 7203324

Structure parameters

• Formula: C10 H10 Br2 Cl6 N2 Pt
• Calculated formula: C10 H10 Br2 Cl6 N2 Pt
• SMILES: c1cc(cc[nH+]1)Br.Cl[Pt](Cl)(Cl)(Cl)([Cl-])[Cl-].c1cc(cc[nH+]1)Br
• Title of publication: Unexpected structural homologies involving hydrogen-bonded and halogen-bonded networks in halopyridinium halometallate salts
• Authors of publication: Fiorenzo Zordan; Guillermo Mínguez Espallargas; Lee Brammer
• Journal of publication: CrystEngComm
• Year of publication: 2006
• Journal volume: 8
• Journal issue: 5
• Pages of publication: 425
• a: 8.5802 ± 0.001 Å
• b: 16.7418 ± 0.0019 Å
• c: 7.0007 ± 0.0008 Å
• α: 90°
• β: 112.504 ± 0.002°
• γ: 90°
• Cell volume: 929.06 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0554
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1651
• Weighted residual factors for all reflections included in the refinement: 0.1685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.137
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No